(E)-2-[[(2S)-2-(methylsulfanylmethyl)pyrrolidin-1-yl]methyl]-1,3-diphenyl-prop-2-en-1-one

Systemtic Name: (E)-2-[[(2S)-2-(methylsulfanylmethyl)pyrrolidin-1-yl]methyl]-1,3-diphenyl-prop-2-en-1-one Openeye Name: (E)-2-[[(2S)-2-(methylsulfanylmethyl)pyrrolidin-1-yl]methyl]-1,3-diphenyl-prop-2-en-1-one CAS Name: (E)-2-[[(2S)-2-[(methylthio)methyl]-1-pyrrolidinyl]methyl]-1,3-diphenyl-2-propen-1-one IUPAC Name: (E)-2-[[(2S)-2-(methylsulfanylmethyl)pyrrolidin-1-yl]methyl]-1,3-diphenylprop-2-en-1-one Traditional Name: (E)-2-[[(2S)-2-[(methylthio)methyl]pyrrolidino]methyl]-1,3-diphenyl-prop-2-en-1-one Formula: C22H25NOS MolecularWeight: 351.505

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1CCCN1CC(=CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CSC[C@@H]1CCCN1C/C(=C\C2=CC=CC=C2)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NOS/c1-25-17-21-13-8-14-23(21)16-20(15-18-9-4-2-5-10-18)22(24)19-11-6-3-7-12-19/h2-7,9-12,15,21H,8,13-14,16-17H2,1H3/b20-15+/t21-/m0/s1